SCHEMBL9833890

SCHEMBL9833890

Cc1ccc2c(c1)CC(=O)N2C(N)=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 3/20 0.65
NOTUM Q6P988 2/20 0.45
AADAT Q8N5Z0 2/20 0.43
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
PABPC1 P11940 1/20 0.41
BLM P54132 1/20 0.41
HSD17B10 Q99714 2/20 0.38
ACHE P22303 1/20 0.37
HPGD P15428 1/20 0.36
SRD5A1 P18405 2/20 0.36
ALOX15 P16050 1/20 0.36
METAP1 P53582 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6690377 0.85 PDE5A (0.67) PDE5ANOTUMAADATALDH1A1KDM4E
SCHEMBL10506330 0.82 PDE5A (0.44) PDE5ANOTUMALDH1A1KDM4EMEN1
SCHEMBL11116301 0.81 NOTUM (0.54) PDE5ANOTUMAADATALDH1A1KDM4E
SCHEMBL9834775 0.81 PDE5A (0.48) PDE5ANOTUMALDH1A1KDM4EMEN1
SCHEMBL7895806 0.81 PDE5A (0.43) PDE5ANOTUMAADATALDH1A1KDM4E
SCHEMBL11006323 0.81 PDE5A (0.43) PDE5ANOTUMALDH1A1KDM4EMEN1
SCHEMBL9834316 0.80 HSD17B10 (0.53) PDE5ANOTUMAADATALDH1A1KDM4E
SCHEMBL2471204 0.79 PDE5A (0.52) PDE5ANOTUMALDH1A1KDM4EMEN1
SCHEMBL10731905 0.79 PDE5A (0.59) PDE5ANOTUMAADATALDH1A1KDM4E
SCHEMBL28350878 0.79 PDE5A (1.00) PDE5ANOTUMALDH1A1MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0208510-B1 1-SUBSTITUTED OXINDOLE-3-CARBOXAMINES AS ANTIINFLAMMATORY AND ANALGESIC AGENTS PFIZER INC. (US) 1991-09-11 EP disclosed
US-4791129-A RHEUMATIC DISEASES; ANTIARTHRITIC AGENTS PFIZER INC. (US) 1988-12-13 US disclosed
US-4725616-A ANTIARTHRITIC AGENTS PFIZER INC. (US) 1988-02-16 US disclosed
EP-0208510-A2 1-Substituted oxindole-3-carboxamines as antiinflammatory and analgesic agents PFIZER INC. (US) 1987-01-14 EP disclosed